methyl 1-[[2-[(4-fluorophenyl)methyl]-4-methyl-1,3-thiazol-5-yl]carbonyl]-4-phenyl-piperidine-4-carboxylate

Systemtic Name: methyl 1-[[2-[(4-fluorophenyl)methyl]-4-methyl-1,3-thiazol-5-yl]carbonyl]-4-phenyl-piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(4-fluorophenyl)methyl]-4-methyl-thiazole-5-carbonyl]-4-phenyl-piperidine-4-carboxylate CAS Name: 1-[[2-[(4-fluorophenyl)methyl]-4-methyl-5-thiazolyl]-oxomethyl]-4-phenyl-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(4-fluorophenyl)methyl]-4-methyl-1,3-thiazole-5-carbonyl]-4-phenylpiperidine-4-carboxylate Traditional Name: 1-[2-(4-fluorobenzyl)-4-methyl-thiazole-5-carbonyl]-4-phenyl-isonipecotic acid methyl ester Formula: C25H25FN2O3S MolecularWeight: 452.541003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=C(C=C2)F)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=C(C=C2)F)C(=O)N3CCC(CC3)(C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C25H25FN2O3S/c1-17-22(32-21(27-17)16-18-8-10-20(26)11-9-18)23(29)28-14-12-25(13-15-28,24(30)31-2)19-6-4-3-5-7-19/h3-11H,12-16H2,1-2H3